3-[[(5E)-5-[(4-bromanyl-3-nitro-phenyl)methylidene]-3-ethyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoate

Systemtic Name: 3-[[(5E)-5-[(4-bromanyl-3-nitro-phenyl)methylidene]-3-ethyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoate Openeye Name: 3-[[(5E)-5-[(4-bromo-3-nitro-phenyl)methylene]-3-ethyl-4-oxo-thiazolidin-2-ylidene]amino]benzoate CAS Name: 3-[[(5E)-5-[(4-bromo-3-nitrophenyl)methylidene]-3-ethyl-4-oxo-2-thiazolidinylidene]amino]benzoate IUPAC Name: 3-[[(5E)-5-[(4-bromo-3-nitrophenyl)methylidene]-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoate Traditional Name: 3-[[(5E)-5-(4-bromo-3-nitro-benzylidene)-3-ethyl-4-keto-thiazolidin-2-ylidene]amino]benzoate Formula: C19H13BrN3O5S- MolecularWeight: 475.29262

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=CC(=C(C=C2)Br)[N+](=O)[O-])SC1=NC3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

CCN1C(=O)/C(=C\C2=CC(=C(C=C2)Br)[N+](=O)[O-])/SC1=NC3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C19H14BrN3O5S/c1-2-22-17(24)16(9-11-6-7-14(20)15(8-11)23(27)28)29-19(22)21-13-5-3-4-12(10-13)18(25)26/h3-10H,2H2,1H3,(H,25,26)/p-1/b16-9+,21-19?